Molecular Formula: C63H80Cl2N5O13Tm
Molecular weight: 1355.17521
InChi: InChI=1S/C56H78N2O6.C6H3N3O7.CH2Cl2.Tm/c1-17-57(18-2)47(59)33-63-51-39-21-35-25-43(53(5,6)7)27-37(49(35)61)23-41-31-46(56(14,15)16)32-42(52(41)64-34-48(60)58(19-3)20-4)24-38-28-44(54(8,9)10)26-36(50(38)62)22-40(51)30-45(29-39)55(11,12)13;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;2-1-3;/h25-32,61-62H,17-24,33-34H2,1-16H3;1-2,10H;1H2;/q;;;+3/p-3
InChi Key: DBAMUTUGIUMTSE-UHFFFAOYSA-K
SMILES: C(Cl)Cl.[Tm+3]123456([O](c7c8Cc9c([O-]4)c(Cc4c([O]1CC(=[O]3)N(CC)CC)c(Cc1c([O-]5)c(Cc7cc(c8)C(C)(C)C)cc(c1)C(C)(C)C)cc(c4)C(C)(C)C)cc(c9)C(C)(C)C)CC(=[O]2)N(CC)CC)[O-]c1c(N(=[O]6)=O)cc(cc1N(=O)=O)N(=O)=O
Chemical Name
[Tm(5,11,17,23-tetra-tert-butyl-25,27-bis(diethylcarbamoylmethoxy)-26,28-dioxycalix[4]arene)(picrate)] * 2.5 CH2Cl2
[Tm(5,11,17,23-tetra-tert-butyl-25,27-bis(diethylcarbamoylmethoxy)-26,28-dioxycalix[4]arene)(picrate)] * 2.5 CH2Cl2